(2S)-2-(cyclohexylcarbonylamino)-N-[3-(4-phenylpiperazin-1-yl)propyl]butanediamide

Systemtic Name: (2S)-2-(cyclohexylcarbonylamino)-N-[3-(4-phenylpiperazin-1-yl)propyl]butanediamide Openeye Name: (2S)-2-(cyclohexanecarbonylamino)-N-[3-(4-phenylpiperazin-1-yl)propyl]butanediamide CAS Name: (2S)-2-[[cyclohexyl(oxo)methyl]amino]-N-[3-(4-phenyl-1-piperazinyl)propyl]butanediamide IUPAC Name: (2S)-2-(cyclohexanecarbonylamino)-N-[3-(4-phenylpiperazin-1-yl)propyl]butanediamide Traditional Name: (2S)-2-(cyclohexanecarbonylamino)-N-[3-(4-phenylpiperazino)propyl]succinamide Formula: C24H37N5O3 MolecularWeight: 443.58228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(CC(=O)N)C(=O)NCCCN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)C(=O)N[C@@H](CC(=O)N)C(=O)NCCCN2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C24H37N5O3/c25-22(30)18-21(27-23(31)19-8-3-1-4-9-19)24(32)26-12-7-13-28-14-16-29(17-15-28)20-10-5-2-6-11-20/h2,5-6,10-11,19,21H,1,3-4,7-9,12-18H2,(H2,25,30)(H,26,32)(H,27,31)/t21-/m0/s1